N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[(8-methyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(5-chloranyl-2,4-dimethoxy-phenyl)-2-[(8-methyl-4-oxidanylidene-1H-quinolin-2-yl)methylsulfanyl]ethanamide Openeye Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[(8-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide CAS Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[(8-methyl-4-oxo-1H-quinolin-2-yl)methylthio]acetamide IUPAC Name: N-(5-chloro-2,4-dimethoxyphenyl)-2-[(8-methyl-4-oxo-1H-quinolin-2-yl)methylsulfanyl]acetamide Traditional Name: N-(5-chloro-2,4-dimethoxy-phenyl)-2-[(4-keto-8-methyl-1H-quinolin-2-yl)methylthio]acetamide Formula: C21H21ClN2O4S MolecularWeight: 432.92044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1NC(=CC2=O)CSCC(=O)NC3=CC(=C(C=C3OC)OC)Cl

Isomeric SMILES

CC1=CC=CC2=C1NC(=CC2=O)CSCC(=O)NC3=CC(=C(C=C3OC)OC)Cl

InChI

InChI=1S/C21H21ClN2O4S/c1-12-5-4-6-14-17(25)7-13(23-21(12)14)10-29-11-20(26)24-16-8-15(22)18(27-2)9-19(16)28-3/h4-9H,10-11H2,1-3H3,(H,23,25)(H,24,26)